methyl 2-[(3-azanyl-4-chloranyl-phenyl)carbonyloxymethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[(3-azanyl-4-chloranyl-phenyl)carbonyloxymethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[(3-amino-4-chloro-benzoyl)oxymethyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[(3-amino-4-chlorophenyl)-oxomethoxy]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[(3-amino-4-chlorobenzoyl)oxymethyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[(3-amino-4-chloro-benzoyl)oxymethyl]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C18H14ClN3O5 MolecularWeight: 387.77386

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)COC(=O)C3=CC(=C(C=C3)Cl)N

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)COC(=O)C3=CC(=C(C=C3)Cl)N

InChI

InChI=1S/C18H14ClN3O5/c1-26-17(24)10-2-4-11-14(7-10)21-15(22-16(11)23)8-27-18(25)9-3-5-12(19)13(20)6-9/h2-7H,8,20H2,1H3,(H,21,22,23)